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CHEBI:126461 - N-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide

ChEBI IDCHEBI:126461
ChEBI NameN-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide
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DownloadsMolfile
FormulaC23H31N3O5S
Net Charge0
Average Mass461.584
Monoisotopic Mass461.19844
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O
InChIInChI=1S/C23H31N3O5S/c1-16-13-26(17(2)15-27)23(28)20-12-18(10-11-21(20)31-22(16)14-25(3)4)24-32(29,30)19-8-6-5-7-9-19/h5-12,16-17,22,24,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1
InChIKeyWIJHLCNCWFONNF-JKSBSHDWSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide (CHEBI:126461) is a sulfonamide (CHEBI:35358)
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